3-Methyl-2-(3-methyl-2-butenyl)-2-cyclopenten-1-one

Base Information

• Chemical Name: 3-Methyl-2-(3-methyl-2-butenyl)-2-cyclopenten-1-one
• CAS No.: 61900-44-5
• Molecular Formula: C11H16O
• Molecular Weight: 164.247
• Hs Code.: 2914299000
• DSSTox Substance ID: DTXSID80563668
• Nikkaji Number: J749.342H

Synonyms:61900-44-5;SCHEMBL440861;DTXSID80563668;3-METHYL-2-(3-METHYL-2-BUTENYL)-2-CYCLOPENTEN-1-ONE;3-Methyl-2-(3-methylbut-2-en-1-yl)cyclopent-2-en-1-one

Chemical Property of 3-Methyl-2-(3-methyl-2-butenyl)-2-cyclopenten-1-one

Chemical Property:

• Boiling Point: 250.7±20.0 °C(Predicted)
• PSA: 17.07000
• Density: 0.938±0.06 g/cm3(Predicted)
• LogP: 3.02210
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 164.120115130
• Heavy Atom Count: 12
• Complexity: 252

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=O)CC1)CC=C(C)C

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